SCHEMBL31624416

SCHEMBL31624416

CC(C)(C)OC(=O)[C@H](CCC(=O)NCCOCCOCC(=O)NCCCC[C@H](NC(=O)OCc1ccccc1)C(=O)OC(c1ccccc1)(c1ccccc1)c1ccccc1Cl)NC(=O)CCCCCCCCCCCCCCCCCCP(=O)(OC(C)(C)C)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 5/20 0.42
▸ GLP1R P43220 8/20 0.40
▸ SIRT1 Q96EB6 2/20 0.38
▸ SIRT3 Q9NTG7 1/20 0.38
▸ BCHE P06276 1/20 0.38
▸ ACHE P22303 1/20 0.38
▸ KLK7 P49862 1/20 0.37
▸ KLK5 Q9Y337 1/20 0.37
▸ TGM2 P21980 2/20 0.36
▸ TGM6 O95932 1/20 0.36
▸ F13A1 P00488 1/20 0.36
▸ TGM1 P22735 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31624510 1.00 SIRT2 (0.42) SIRT2GLP1RSIRT1SIRT3BCHE
SCHEMBL31624450 1.00 SIRT2 (0.42) SIRT2GLP1RSIRT1SIRT3BCHE
SCHEMBL31624589 1.00 SIRT2 (0.42) SIRT2GLP1RSIRT1SIRT3BCHE
SCHEMBL31631377 0.92 SIRT2 (0.44) SIRT2GLP1RSIRT1SIRT3BCHE
SCHEMBL31624430 0.91 SIRT2 (0.49) SIRT2SIRT1SIRT3KLK7KLK5
SCHEMBL31624487 0.91 SIRT2 (0.49) SIRT2SIRT1SIRT3KLK7KLK5
SCHEMBL31624428 0.90 GLP1R (0.49) SIRT2GLP1RSIRT1SIRT3KLK7
SCHEMBL31624398 0.90 GLP1R (0.49) SIRT2GLP1RSIRT1SIRT3KLK7
SCHEMBL31624457 0.90 GLP1R (0.49) SIRT2GLP1RSIRT1SIRT3KLK7
SCHEMBL31624472 0.90 GLP1R (0.49) SIRT2GLP1RSIRT1SIRT3KLK7

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025128626-A1 HYBRID PEPTIDE COMPOUNDS HAVING A MODIFIED LYSINE RESIDUE CARMOT THERAPEUTICS, INC. (US) 2025-06-19 — — WO disclosed
WO-2025128624-A2 HYBRID PEPTIDE COMPOUNDS HAVING A SUBSTITUTED TRYPTOPHAN RESIDUE OR A TERMINAL SUBSTITUENT CARMOT THERAPEUTICS, INC. (US) 2025-06-19 — — WO disclosed
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